6-(difluoromethyl)-3-ethylpyrazin-2-amine

C7H9F2N3 — CID 162562681

IUPAC6-(difluoromethyl)-3-ethylpyrazin-2-amine
SMILESCCc1ncc(C(F)F)nc1N
InChIInChI=1S/C7H9F2N3/c1-2-4-7(10)12-5(3-11-4)6(8)9/h3,6H,2H2,1H3,(H2,10,12)
InChIKeyUXSANCGTBRQWRW-UHFFFAOYSA-N
MW173.17 g/mol
LogP1.56
Rot. Bonds2

About 6-(difluoromethyl)-3-ethylpyrazin-2-amine

6-(difluoromethyl)-3-ethylpyrazin-2-amine (PubChem CID 162562681) has the molecular formula C7H9F2N3 and a molecular weight of 173.17 g/mol. Its IUPAC name is 6-(difluoromethyl)-3-ethylpyrazin-2-amine.

Molecular Properties

Compound Name6-(difluoromethyl)-3-ethylpyrazin-2-amine
PubChem CID162562681
Molecular FormulaC7H9F2N3
Molecular Weight173.17 g/mol
Exact Mass173.08
IUPAC Name6-(difluoromethyl)-3-ethylpyrazin-2-amine
SMILESCCc1ncc(C(F)F)nc1N
InChIInChI=1S/C7H9F2N3/c1-2-4-7(10)12-5(3-11-4)6(8)9/h3,6H,2H2,1H3,(H2,10,12)
InChIKeyUXSANCGTBRQWRW-UHFFFAOYSA-N
XLogP1.56
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.17
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-3-ethylpyrazin-2-amine?
The IUPAC name of 6-(difluoromethyl)-3-ethylpyrazin-2-amine (CID 162562681) is 6-(difluoromethyl)-3-ethylpyrazin-2-amine.
What is the SMILES notation for 6-(difluoromethyl)-3-ethylpyrazin-2-amine?
The canonical SMILES for 6-(difluoromethyl)-3-ethylpyrazin-2-amine is CCc1ncc(C(F)F)nc1N.
What is the InChIKey of 6-(difluoromethyl)-3-ethylpyrazin-2-amine?
The InChIKey is UXSANCGTBRQWRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F2N3/c1-2-4-7(10)12-5(3-11-4)6(8)9/h3,6H,2H2,1H3,(H2,10,12).
What are the key properties of 6-(difluoromethyl)-3-ethylpyrazin-2-amine?
6-(difluoromethyl)-3-ethylpyrazin-2-amine has a molecular weight of 173.17 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-3-ethylpyrazin-2-amine is sourced from PubChem (CID 162562681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).